(dodecanoyloxy)dimethylstannyl dodecanoate

• ChemBase编号: 112332
• 分子式: C26H52O4Sn
• 平均质量: 547.38968
• 单一同位素质量: 548.28875414
• SMILES: CCCCCCCCCCCC(=O)O[Sn](C)(C)OC(=O)CCCCCCCCCCC
• Canonical SMILES: CCCCCCCCCCCC(=O)O[Sn](OC(=O)CCCCCCCCCCC)(C)C
• InChI: InChI=1S/2C12H24O2.2CH3.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12(13)14;;;/h2*2-11H2,1H3,(H,13,14);2*1H3;/q;;;;+2/p-2
• InChIKey: LYYNQLKRDKNQMN-UHFFFAOYSA-L

名称和登记号

名称

• IUPAC标准名: (dodecanoyloxy)dimethylstannyl dodecanoate
• IUPAC传统名: (dodecanoyloxy)dimethylstannyl dodecanoate
• 别名: DIMETHYL TIN DILAURATE

登记号

• CAS号: 2179-99-9
• PubChem SID: 162097448
• PubChem CID: 16683112

理论计算性质

• 质子受体: 2
• 质子供体: 0
• LogD (pH = 5.5): 6.4298
• LogD (pH = 7.4): 6.4298
• Log P: 6.4298
• 摩尔折射率: 127.3954 cm^3
• 极化性: 55.49469 Å^3
• 极化表面积: 52.6 Å^2
• 可自由旋转的化学键: 24
• 里宾斯基五规则: false

详细说明

MP Biomedicals - 05223528

MP Biomedicals Rare Chemical collection